Crystallography Open Database

Information card for entry 4341895

Preview

Coordinates	4341895.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Au4.44 Eu1.1 Ga2.18
Calculated formula	Au4.44 Eu1.10533 Ga2.18033
Title of publication	Crystal Structure and Bonding in BaAu5Ga2 and AeAu4+xGa3-x (Ae = Ba and Eu): Hexagonal Diamond-Type Au Frameworks and Remarkable Cation/Anion Partitioning in the Ae-Au-Ga Systems.
Authors of publication	Smetana, Volodymyr; Steinberg, Simon; Card, Nathan; Mudring, Anja-Verena; Miller, Gordon J.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	3
Pages of publication	1010 - 1018
a	8.5277 ± 0.0011 Å
b	8.5277 ± 0.0011 Å
c	7.2451 ± 0.0012 Å
α	90°
β	90°
γ	120°
Cell volume	456.29 ± 0.11 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
Space group number	189
Hermann-Mauguin space group symbol	P -6 2 m
Hall space group symbol	P -6 -2
Residual factor for all reflections	0.0468
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.0619
Weighted residual factors for all reflections included in the refinement	0.0678
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4341895.cif
130549	2015-02-04	cif/ Updating files of 4341895, 4341896, 4341897, 4341898, 4341899, 4341900, 4341901, 4341902, 4341903 Original log message: Adding full bibliography for 4341895--4341903.cif.	4341895.cif
128611	2014-12-13	cif/ Adding structures of 4341895, 4341896, 4341897, 4341898, 4341899, 4341900, 4341901, 4341902, 4341903 via cif-deposit CGI script.	4341895.cif